(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol

C18H26O — CID 107193020

IUPAC(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol
SMILESCC1(C)CCCCC1C(O)C1CC1c1ccccc1
InChIInChI=1S/C18H26O/c1-18(2)11-7-6-10-16(18)17(19)15-12-14(15)13-8-4-3-5-9-13/h3-5,8-9,14-17,19H,6-7,10-12H2,1-2H3
InChIKeyCEVGIXNJZBTADI-UHFFFAOYSA-N
MW258.40 g/mol
LogP4.37
Rot. Bonds3

About (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol

(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol (PubChem CID 107193020) has the molecular formula C18H26O and a molecular weight of 258.40 g/mol. Its IUPAC name is (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol.

Molecular Properties

Compound Name(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol
PubChem CID107193020
Molecular FormulaC18H26O
Molecular Weight258.40 g/mol
Exact Mass258.20
IUPAC Name(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol
SMILESCC1(C)CCCCC1C(O)C1CC1c1ccccc1
InChIInChI=1S/C18H26O/c1-18(2)11-7-6-10-16(18)17(19)15-12-14(15)13-8-4-3-5-9-13/h3-5,8-9,14-17,19H,6-7,10-12H2,1-2H3
InChIKeyCEVGIXNJZBTADI-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol?
The IUPAC name of (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol (CID 107193020) is (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol.
What is the SMILES notation for (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol?
The canonical SMILES for (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol is CC1(C)CCCCC1C(O)C1CC1c1ccccc1.
What is the InChIKey of (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol?
The InChIKey is CEVGIXNJZBTADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O/c1-18(2)11-7-6-10-16(18)17(19)15-12-14(15)13-8-4-3-5-9-13/h3-5,8-9,14-17,19H,6-7,10-12H2,1-2H3.
What are the key properties of (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol?
(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol has a molecular weight of 258.40 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol is sourced from PubChem (CID 107193020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).